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(3RS,4RS)-3-Acetoxy-4,5,8-trihydroxy-3-methyl-1,2,3,4-tetrahydro-9,10-anthraquinone
SpectraBase Compound ID 5rzJGbzujTw
InChI InChI=1S/C17H16O7/c1-7(18)24-17(2)6-5-8-11(16(17)23)15(22)13-10(20)4-3-9(19)12(13)14(8)21/h3-4,16,19-20,23H,5-6H2,1-2H3
InChIKey LLKBSUXDVGHXKR-UHFFFAOYSA-N
Mol Weight 332.31 g/mol
Molecular Formula C17H16O7
Exact Mass 332.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EEnCzZGRQsP
Name (3RS,4RS)-3-Acetoxy-4,5,8-trihydroxy-3-methyl-1,2,3,4-tetrahydro-9,10-anthraquinone
Alternate Name(s) 1,5,8-trihydroxy-2-methyl-9,10-dioxo-1,2,3,4,9,10-hexahydro-2-anthracenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O7
InChI InChI=1S/C17H16O7/c1-7(18)24-17(2)6-5-8-11(16(17)23)15(22)13-10(20)4-3-9(19)12(13)14(8)21/h3-4,16,19-20,23H,5-6H2,1-2H3
InChIKey LLKBSUXDVGHXKR-UHFFFAOYSA-N
Molecular Weight 332.308 g/mol
SMILES Oc1c2C(C3=C(C(c2c(cc1)O)=O)C(C(CC3)(OC(=O)C)C)O)=O
SPLASH splash10-00dl-2090000000-da3218f4d816e039679c
Source of Spectrum B-44-1441-24
Wiley ID 1329260